SCHEMBL11402829

SCHEMBL11402829

CCCCN1C(=O)NC(Cc2ccc(COCCO)cc2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
POLB P06746 2/20 0.40
KDM4A O75164 1/20 0.40
USP2 O75604 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MMP1 P03956 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
PLA2G10 O15496 1/20 0.36
PLA2G5 P39877 1/20 0.36
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
NR4A2 P43354 1/20 0.34
GAA P10253 2/20 0.34
ITGA4 P13612 1/20 0.34
ITGB7 P26010 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11267916 0.84 CAPN1 (0.48) ALOX15L3MBTL1POLBKDM4AUSP2
SCHEMBL11270328 0.79 POLB (0.47) ALOX15L3MBTL1POLBKDM4AUSP2
SCHEMBL11256499 0.79 NPSR1 (0.49) ALOX15L3MBTL1POLBKDM4AUSP2
SCHEMBL11263507 0.79 LMNA (0.47) ALOX15L3MBTL1POLBKDM4AUSP2
SCHEMBL8726366 0.79 PLA2G10 (0.56) ALOX15L3MBTL1POLBHDAC1HDAC6
SCHEMBL11264004 0.78 MMP1 (0.40) ALOX15L3MBTL1POLBKDM4AUSP2
SCHEMBL11257403 0.78 RAB9A (0.53) ALOX15L3MBTL1POLBHDAC1HDAC6
SCHEMBL11265232 0.77 PLA2G10 (0.48) ALOX15L3MBTL1POLBHDAC1HDAC6
SCHEMBL11266748 0.77 L3MBTL1 (0.42) ALOX15L3MBTL1POLBKDM4AUSP2
SCHEMBL11263373 0.76 KMT2A (0.52) ALOX15L3MBTL1POLBKDM4AUSP2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4293563-A ANTIASTHMATICS LILLY INDUSTRIES LIMITED (GB) 1981-10-06 US disclosed
US-4241073-A ASTHMA LILLY INDUSTRIES LIMITED (GB) 1980-12-23 US disclosed
EP-0005647-A1 Hydantoin compounds, their preparation and pharmaceutical formulations containing them Lilly Industries Limited (GB) 1979-11-28 EP disclosed